N-[(3-methoxyphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-m-anisyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-isonipecotamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H28N4O4S/c1-14-19(15(2)23(3)22-14)29(26,27)24-10-8-17(9-11-24)20(25)21-13-16-6-5-7-18(12-16)28-4/h5-7,12,17H,8-11,13H2,1-4H3,(H,21,25)